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Information card for entry 7056851
Preview
| Coordinates | 7056851.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C60 H57 N17 O18 Zn3 |
|---|---|
| Calculated formula | C60 H57 N17 O18 Zn3 |
| Title of publication | Enhanced activity of trinuclear Zn(ii) complexes towards phosphate ester bond cleavage by introducing three-metal cooperativity |
| Authors of publication | Joshi, Pooja; Hussain, Navid; Ali, Shah Raj; Rishu, Rishu; Bhardwaj, Vimal K. |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2018 |
| Journal volume | 42 |
| Journal issue | 3 |
| Pages of publication | 2204 |
| a | 14.083 ± 0.0009 Å |
| b | 14.4192 ± 0.0009 Å |
| c | 18.1214 ± 0.0012 Å |
| α | 82.062 ± 0.002° |
| β | 80.733 ± 0.002° |
| γ | 67.905 ± 0.002° |
| Cell volume | 3353 ± 0.4 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0476 |
| Residual factor for significantly intense reflections | 0.0371 |
| Weighted residual factors for significantly intense reflections | 0.1004 |
| Weighted residual factors for all reflections included in the refinement | 0.1054 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7056851.cif |
| 230562 | 2019-11-17 | cif/ Updating files of 7056849, 7056850, 7056851 Original log message: Adding full bibliography for 7056849--7056851.cif. |
7056851.cif |
| 204563 | 2017-12-28 | cif/ Adding structures of 7056849, 7056850, 7056851 via cif-deposit CGI script. |
7056851.cif |
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Users of the data should acknowledge the original authors of the
structural data.